N-[[2-(diethylamino)pyridin-3-yl]methyl]isoquinoline-1-carboxamide

Systemtic Name: N-[[2-(diethylamino)pyridin-3-yl]methyl]isoquinoline-1-carboxamide Openeye Name: N-[[2-(diethylamino)-3-pyridyl]methyl]isoquinoline-1-carboxamide CAS Name: N-[[2-(diethylamino)-3-pyridinyl]methyl]-1-isoquinolinecarboxamide IUPAC Name: N-[[2-(diethylamino)pyridin-3-yl]methyl]isoquinoline-1-carboxamide Traditional Name: N-[[2-(diethylamino)-3-pyridyl]methyl]isoquinoline-1-carboxamide Formula: C20H22N4O MolecularWeight: 334.41488

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=CC=N1)CNC(=O)C2=NC=CC3=CC=CC=C32

Isomeric SMILES

CCN(CC)C1=C(C=CC=N1)CNC(=O)C2=NC=CC3=CC=CC=C32

InChI

InChI=1S/C20H22N4O/c1-3-24(4-2)19-16(9-7-12-22-19)14-23-20(25)18-17-10-6-5-8-15(17)11-13-21-18/h5-13H,3-4,14H2,1-2H3,(H,23,25)